SCHEMBL6879552

SCHEMBL6879552

O=C(O)c1cnc(N(c2ccccc2)c2ccccc2)nc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.55
KDM4E B2RXH2 1/20 0.55
ALOX15 P16050 1/20 0.55
HSD17B10 Q99714 1/20 0.55
HDAC6 Q9UBN7 7/20 0.54
HDAC1 Q13547 4/20 0.50
HDAC3 O15379 3/20 0.50
HDAC2 Q92769 3/20 0.50
HDAC8 Q9BY41 3/20 0.50
HDAC7 Q8WUI4 2/20 0.50
HDAC4 P56524 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
NCOR2 Q9Y618 1/20 0.50
MGAM O43451 1/20 0.49
LDHA P00338 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
P4HA1 P13674 2/20 0.44
P4HTM Q9NXG6 2/20 0.44
NAPRT Q6XQN6 2/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18297026 0.86 HDAC6 (0.47) ALDH1A1KDM4EALOX15HSD17B10HDAC6
SCHEMBL16624609 0.85 HDAC6 (0.57) ALDH1A1KDM4EALOX15HSD17B10HDAC6
SCHEMBL18294907 0.85 HDAC6 (0.51) ALDH1A1KDM4EALOX15HSD17B10HDAC6
SCHEMBL21943233 0.85 HDAC6 (0.51) ALDH1A1KDM4EALOX15HSD17B10HDAC6
SCHEMBL24488778 0.84 HDAC6 (0.58) ALDH1A1KDM4EALOX15HSD17B10HDAC6
SCHEMBL19267854 0.81 HDAC6 (0.58) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL6881495 0.79 P2RY12 (0.49) ALDH1A1HDAC6HDAC1HDAC3HDAC2
SCHEMBL11562123 0.78 HCAR3 (0.57) ALDH1A1HSD17B10MGAMLDHAP4HA1
SCHEMBL19267853 0.77 HDAC6 (0.54) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL18542037 0.76 TDP1 (0.57) ALDH1A1KDM4EHDAC6HDAC1HDAC3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 135 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11872227-B2 Pharmaceutical combinations comprising a histone deacetylase inhibitor and an aurora kinase inhibitor and methods of use thereof ACETYLON PHARMACEUTICALS, INC. (US) 2024-01-16 US disclosed
US-11872227-B2 Pharmaceutical combinations comprising a histone deacetylase inhibitor and an aurora kinase inhibitor and methods of use thereof ACETYLON PHARMACEUTICALS, INC. (US) 2024-01-16 US disclosed
EP-3468559-B1 METHODS OF USE AND PHARMACEUTICAL COMBINATIONS OF HDAC INHIBITORS WITH BET INHIBITORS DANA FARBER CANCER INST INC (US) 2023-11-22 EP disclosed
US-20230364083-A1 HISTONE DEACETYLASE 6 (HDAC6) BIOMARKERS IN MULTIPLE MYELOMA ACETYLON PHARMACEUTICALS, INC. 2023-11-16 US disclosed
US-20230364083-A1 HISTONE DEACETYLASE 6 (HDAC6) BIOMARKERS IN MULTIPLE MYELOMA ACETYLON PHARMACEUTICALS, INC. 2023-11-16 US disclosed
US-11813261-B2 HDAC inhibitors, alone or in combination with BTK inhibitors, for treating chronic lymphocytic leukemia ACETYLON PHARMACEUTICALS, INC. (US) 2023-11-14 US disclosed
US-11813261-B2 HDAC inhibitors, alone or in combination with BTK inhibitors, for treating chronic lymphocytic leukemia ACETYLON PHARMACEUTICALS, INC. (US) 2023-11-14 US disclosed
US-20230190744-A1 PHARMACEUTICAL COMBINATIONS COMPRISING A HISTONE DEACETYLASE INHIBITOR AND A PROGRAMMED DEATH-LIGAND 1 (PD-L1) INHIBITOR AND METHODS OF USE THEREOF ACETYLON PHARMACEUTICALS INC (US) 2023-06-22 US disclosed
US-11666568-B2 Pharmaceutical combinations comprising a histone deacetylase inhibitor and a BCL-2 inhibitor and methods of use thereof ACETYLON PHARMACEUTICALS, INC. (US) 2023-06-06 US disclosed
US-11666568-B2 Pharmaceutical combinations comprising a histone deacetylase inhibitor and a BCL-2 inhibitor and methods of use thereof ACETYLON PHARMACEUTICALS, INC. (US) 2023-06-06 US disclosed
WO-2013013113-A2 HISTONE DEACETYLASE 6 SELECTIVE INHIBITORS FOR THE TREATMENT OF BONE DISEASE THE GENERAL HOSPITAL CORPORATION (US) 2013-01-24 WO disclosed
US-20120190693-A1 Reverse Amide Compounds As Protein Deacetylase Inhibitors And Methods Of Use Thereof ACETYLON PHARMACEUTICALS, INC. 2012-07-26 US disclosed
US-20120190693-A1 Reverse Amide Compounds As Protein Deacetylase Inhibitors And Methods Of Use Thereof ACETYLON PHARMACEUTICALS, INC. 2012-07-26 US disclosed
US-20120083504-A1 Reverse Amide Compounds As Protein Deacetylase Inhibitors And Methods Of Use Thereof ACETYLON PHARMACEUTICALS, INC. 2012-04-05 US disclosed
US-20120083504-A1 Reverse Amide Compounds As Protein Deacetylase Inhibitors And Methods Of Use Thereof ACETYLON PHARMACEUTICALS, INC. 2012-04-05 US disclosed
US-8148526-B1 Reverse amide compounds as protein deacetylase inhibitors and methods of use thereof ACETYLON PHARMACEUTICALS (US) 2012-04-03 US disclosed
US-8148526-B1 Reverse amide compounds as protein deacetylase inhibitors and methods of use thereof ACETYLON PHARMACEUTICALS (US) 2012-04-03 US disclosed
US-20110300134-A1 REVERSE AMIDE COMPOUNDS AS PROTEIN DEACETYLASE INHIBITORS AND METHODS OF USE THEREOF ACETYLON PHARMACEUTICALS (US) 2011-12-08 US disclosed
US-20110300134-A1 REVERSE AMIDE COMPOUNDS AS PROTEIN DEACETYLASE INHIBITORS AND METHODS OF USE THEREOF ACETYLON PHARMACEUTICALS (US) 2011-12-08 US disclosed
WO-2011091213-A2 REVERSE AMIDE COMPOUNDS AS PROTEIN DEACETYLASE INHIBITORS AND METHODS OF USE THEREOF ACETYLON PHARMACEUTICALS (US) 2011-07-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110300134-A1 REVERSE AMIDE COMPOUNDS AS PROTEIN DEACETYLASE INHIBITORS AND METHODS OF USE THEREOF HDAC6, HDAC1, HDAC3 ALDH1A1 2570/4885KDM4E 1559/4885ALOX15 4661/4885
US-20230364083-A1 HISTONE DEACETYLASE 6 (HDAC6) BIOMARKERS IN MULTIPLE MYELOMA HDAC5, HDAC6, HDAC9 ALDH1A1 1018/4885KDM4E 66/4885ALOX15 4791/4885
US-11813261-B2 HDAC inhibitors, alone or in combination with BTK inhibitors, for treating chronic lymphocytic leukemia BTK, HDAC2, HDAC4 ALDH1A1 3843/4885KDM4E 246/4885ALOX15 3229/4885
US-20230190744-A1 PHARMACEUTICAL COMBINATIONS COMPRISING A HISTONE DEACETYLASE INHIBITOR AND A PROGRAMMED DEATH-LIGAND 1 (PD-L1) INHIBITOR AND METHODS OF USE THEREOF HDAC1, HDAC3, HDAC8 ALDH1A1 791/4885KDM4E 416/4885ALOX15 3773/4885
US-11666568-B2 Pharmaceutical combinations comprising a histone deacetylase inhibitor and a BCL-2 inhibitor and methods of use thereof BCL2, HDAC1, HDAC3 ALDH1A1 2067/4885KDM4E 1021/4885ALOX15 4234/4885
US-20120190693-A1 Reverse Amide Compounds As Protein Deacetylase Inhibitors And Methods Of Use Thereof HDAC6, HDAC1, HDAC3 ALDH1A1 2570/4885KDM4E 1559/4885ALOX15 4661/4885
US-20120083504-A1 Reverse Amide Compounds As Protein Deacetylase Inhibitors And Methods Of Use Thereof HDAC6, HDAC1, HDAC3 ALDH1A1 2570/4885KDM4E 1559/4885ALOX15 4661/4885
US-11872227-B2 Pharmaceutical combinations comprising a histone deacetylase inhibitor and an aurora kinase inhibitor and methods of use thereof HDAC1, HDAC3, HDAC8 ALDH1A1 2993/4885KDM4E 741/4885ALOX15 4767/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.